Crystallography Open Database

Information card for entry 4316154

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Coordinates	4316154.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C37 H28 N5 O6 Re2
Calculated formula	C37 H28 N5 O6 Re2
Title of publication	Highly Emissive Cyclometalated Rhenium Metallacycles: Structure-Luminescence Relationship
Authors of publication	Yi-Hsiu Tseng; Dibyendu Bhattacharya; Shih-Ming Lin; P. Thanasekaran; Jing-Yun Wu; Li-Wei Lee; M. Sathiyendiran; Mei-Lin Ho; Min-Wen Chung; Kung-Chung Hsu; Pi-Tai Chou; Kuang-Lieh Lu
Journal of publication	Inorganic Chemistry
Year of publication	2010
Journal volume	49
Pages of publication	6805 - 6807
a	11.698 ± 0.0017 Å
b	11.698 ± 0.0017 Å
c	48.265 ± 0.01 Å
α	90°
β	90°
γ	120°
Cell volume	5719.9 ± 1.7 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	5
Space group number	179
Hermann-Mauguin space group symbol	P 65 2 2
Hall space group symbol	P 65 2 (0 0 1)
Residual factor for all reflections	0.0545
Residual factor for significantly intense reflections	0.0389
Weighted residual factors for significantly intense reflections	0.1064
Weighted residual factors for all reflections included in the refinement	0.1265
Goodness-of-fit parameter for all reflections included in the refinement	1.089
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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